U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H26O3
Molecular Weight 254.3651
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 15-HYDROXYCULMORIN

SMILES

[H][C@]12[C@H](O)C[C@]3(C)[C@H](O)[C@@]1([H])[C@@](C)(CO)CCC[C@]23C

InChI

InChIKey=OLWYTMKUCGVHCZ-IKIFBEIWSA-N
InChI=1S/C15H26O3/c1-13(8-16)5-4-6-14(2)10-9(17)7-15(14,3)12(18)11(10)13/h9-12,16-18H,4-8H2,1-3H3/t9-,10+,11+,12-,13-,14-,15-/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H26O3
Molecular Weight 254.3651
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:49:13 UTC 2023
Edited
by admin
on Sat Dec 16 14:49:13 UTC 2023
Record UNII
D1RJ8P25E6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
15-HYDROXYCULMORIN
Common Name English
(1S,3R,3AS,4R,5S,8AR,9R)-DECAHYDRO-5-(HYDROXYMETHYL)-1,5,8A-TRIMETHYL-1,4-METHANOAZULENE-3,9-DIOL
Systematic Name English
1,4-METHANOAZULENE-3,9-DIOL, DECAHYDRO-5-(HYDROXYMETHYL)-1,5,8A-TRIMETHYL-, (1S,3R,3AS,4R,5S,8AR,9R)-
Systematic Name English
Code System Code Type Description
CAS
144447-99-4
Created by admin on Sat Dec 16 14:49:13 UTC 2023 , Edited by admin on Sat Dec 16 14:49:13 UTC 2023
PRIMARY
PUBCHEM
38352728
Created by admin on Sat Dec 16 14:49:13 UTC 2023 , Edited by admin on Sat Dec 16 14:49:13 UTC 2023
PRIMARY
EPA CompTox
DTXSID301017489
Created by admin on Sat Dec 16 14:49:13 UTC 2023 , Edited by admin on Sat Dec 16 14:49:13 UTC 2023
PRIMARY
FDA UNII
D1RJ8P25E6
Created by admin on Sat Dec 16 14:49:13 UTC 2023 , Edited by admin on Sat Dec 16 14:49:13 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT